2-[4-[(3,4-dichlorophenyl)sulfonylamino]phenyl]-N-methylsulfonylacetamide

C15H14Cl2N2O5S2 — CID 155546929

IUPAC2-[4-[(3,4-dichlorophenyl)sulfonylamino]phenyl]-N-methylsulfonylacetamide
SMILESCS(=O)(=O)NC(=O)Cc1ccc(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)cc1
InChIInChI=1S/C15H14Cl2N2O5S2/c1-25(21,22)19-15(20)8-10-2-4-11(5-3-10)18-26(23,24)12-6-7-13(16)14(17)9-12/h2-7,9,18H,8H2,1H3,(H,19,20)
InChIKeyHUTZPFRSAVKWGC-UHFFFAOYSA-N
MW437.33 g/mol
LogP2.41
Rot. Bonds6

About 2-[4-[(3,4-dichlorophenyl)sulfonylamino]phenyl]-N-methylsulfonylacetamide

2-[4-[(3,4-dichlorophenyl)sulfonylamino]phenyl]-N-methylsulfonylacetamide (PubChem CID 155546929) has the molecular formula C15H14Cl2N2O5S2 and a molecular weight of 437.33 g/mol. Its IUPAC name is 2-[4-[(3,4-dichlorophenyl)sulfonylamino]phenyl]-N-methylsulfonylacetamide.

Molecular Properties

Compound Name2-[4-[(3,4-dichlorophenyl)sulfonylamino]phenyl]-N-methylsulfonylacetamide
PubChem CID155546929
Molecular FormulaC15H14Cl2N2O5S2
Molecular Weight437.33 g/mol
Exact Mass435.97
IUPAC Name2-[4-[(3,4-dichlorophenyl)sulfonylamino]phenyl]-N-methylsulfonylacetamide
SMILESCS(=O)(=O)NC(=O)Cc1ccc(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)cc1
InChIInChI=1S/C15H14Cl2N2O5S2/c1-25(21,22)19-15(20)8-10-2-4-11(5-3-10)18-26(23,24)12-6-7-13(16)14(17)9-12/h2-7,9,18H,8H2,1H3,(H,19,20)
InChIKeyHUTZPFRSAVKWGC-UHFFFAOYSA-N
XLogP2.41
TPSA109.41 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.33
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

S-[2-[4-[(3,4-dichlorophenyl)sulfonylamino]phenyl]-2-oxoethyl] ethanethioate
CID 11362090
(E)-3-[4-(3,4-Dichloro-benzenesulfonylamino)-phenyl]-N-hydroxy-acrylamide
CID 22986772
5-[4-[(4-chlorophenyl)sulfonylamino]phenyl]-N-hydroxy-4-methylpentanamide
CID 11326952
N-(4-butan-2-ylphenyl)-2-[4-[(3,4-dichlorophenyl)sulfonylamino]phenyl]acetamide
CID 42910777
3-[(3,4-dichlorophenyl)sulfonylamino]-N-methoxybenzamide
CID 33102554
(4-{[(3,4-Dichlorophenyl)sulfonyl]amino}phenyl)acetic acid
CID 2116937
2-[4-(3-chloro-4-fluorobenzenesulfonamido)phenyl]-N-methylacetamide
CID 25891191
3-chloro-4-[(3,4-dichlorophenyl)sulfonylamino]-N,N-dimethylbenzamide
CID 76334762
2-[4-[(4-chloro-2-fluorophenyl)sulfonylamino]phenyl]-N-methylacetamide
CID 8124930
2-(4-(3-chloro-4-fluorophenylsulfonamido)phenyl)-N,N-dimethylacetamide
CID 25890475
2-(4-(3-Chloro-4-fluorophenylsulfonamido)phenyl)acetamide
CID 25890584
5-[(3,4-Dichlorophenyl)sulfonylamino]-2-fluorobenzamide
CID 39331681

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(3,4-dichlorophenyl)sulfonylamino]phenyl]-N-methylsulfonylacetamide?
The IUPAC name of 2-[4-[(3,4-dichlorophenyl)sulfonylamino]phenyl]-N-methylsulfonylacetamide (CID 155546929) is 2-[4-[(3,4-dichlorophenyl)sulfonylamino]phenyl]-N-methylsulfonylacetamide.
What is the SMILES notation for 2-[4-[(3,4-dichlorophenyl)sulfonylamino]phenyl]-N-methylsulfonylacetamide?
The canonical SMILES for 2-[4-[(3,4-dichlorophenyl)sulfonylamino]phenyl]-N-methylsulfonylacetamide is CS(=O)(=O)NC(=O)Cc1ccc(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)cc1.
What is the InChIKey of 2-[4-[(3,4-dichlorophenyl)sulfonylamino]phenyl]-N-methylsulfonylacetamide?
The InChIKey is HUTZPFRSAVKWGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2N2O5S2/c1-25(21,22)19-15(20)8-10-2-4-11(5-3-10)18-26(23,24)12-6-7-13(16)14(17)9-12/h2-7,9,18H,8H2,1H3,(H,19,20).
What are the key properties of 2-[4-[(3,4-dichlorophenyl)sulfonylamino]phenyl]-N-methylsulfonylacetamide?
2-[4-[(3,4-dichlorophenyl)sulfonylamino]phenyl]-N-methylsulfonylacetamide has a molecular weight of 437.33 g/mol, XLogP of 2.41, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(3,4-dichlorophenyl)sulfonylamino]phenyl]-N-methylsulfonylacetamide is sourced from PubChem (CID 155546929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).